canSAR1631806
FEATURES
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NAMES
    SMILES
    O=C([O-])C(=O)Cc1ccccc1
    InChI
    InChI=1S/C9H8O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,11,12)/p-1
    MOLECULAR FORMULA
    C9H7O3-
    CROSS REFERENCES
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    canSAR1631806
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight163.04
    AlogP-0.45
    HBond donors0
    HBond acceptors3
    Atoms19
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1631806.